cell_volume         :real:0:
  0.107869349241422E+004
orbital_charges     :real:2:4,8
  0.150473864912320E+001  0.833523441106451E+000  0.837178369924465E+000
  0.830162237451730E+000  0.149389966138051E+001  0.828682311772224E+000
  0.831072622023540E+000  0.827588068205380E+000  0.146553647655280E+001
  0.819086329051578E+000  0.823048693684202E+000  0.822602806057928E+000
  0.148705060000765E+001  0.826718093832489E+000  0.830061535935474E+000
  0.826946320501232E+000  0.150615595819416E+001  0.833804115790926E+000
  0.830454374068871E+000  0.837997735408392E+000  0.151246675142472E+001
  0.836702017339897E+000  0.833772524685777E+000  0.837047571798290E+000
  0.153200822361433E+001  0.845096679794763E+000  0.841012455058429E+000
  0.841610500756369E+000  0.151430386946221E+001  0.837632623948052E+000
  0.834709308586548E+000  0.837329073457428E+000
forces              :real:2:3,8
  0.536642026579984E-002  0.123821826415377E-001 -0.536602550135163E-002
 -0.153463217419521E-001 -0.164482313444970E-001  0.998577655708188E-002
  0.127794157987339E-002  0.339010765473070E-002 -0.124001726338975E-001
  0.978198307625414E-002 -0.524330393683214E-002  0.143101189623391E-001
 -0.395619304884281E-002  0.227877286694153E-002  0.268138182536107E-002
  0.103967803866083E-001 -0.159174725988833E-002 -0.456986455735173E-002
 -0.344734284559294E-002  0.851548055383901E-002  0.829772870723141E-002
 -0.407326767214783E-002 -0.328326117583147E-002 -0.129389433594125E-001
stress              :real:2:3,3
  0.633475851889078E-004  0.119015163274854E-004 -0.388217514599619E-004
  0.119015164332236E-004  0.621771370797475E-004  0.858132673268838E-006
 -0.388217539417267E-004  0.858131623428135E-006  0.622636448194394E-004
mermin_energy       :real:0:
 -0.103685414698563E+002
end_coords          :real:2:3,8
 -0.344628765515247E-001 -0.336062155571504E-001  0.677397881875041E-001
  0.270258697925580E+001  0.264338622610040E+001  0.247493446656285E+001
  0.516272021713400E+001  0.515147539755025E+001  0.321740038264480E-001
  0.762010820706426E+001  0.772051094995182E+001  0.251169834075936E+001
  0.511121880872926E+001 -0.223639958194509E-001  0.513132608833535E+001
  0.763365349353918E+001  0.255761609095961E+001  0.771763827830996E+001
  0.223591630018633E-001  0.506469938996317E+001  0.504485586873141E+001
  0.254896639227236E+001  0.768543254127764E+001  0.778678354973231E+001
